Vitas-M small molecule compound

(2E)-N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-(3-nitrophenyl)prop-2-enamide

Catalog ID
STK236827
SMILES O=C(Nc1ccc2c(c1)nc(o2)c1ccc(cc1Cl)F)/C=C/c1cccc(c1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H13ClFN3O4 MW 437.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13ClFN3O4/c23-18-11-14(24)5-7-17(18)22-26-19-12-15(6-8-20(19)31-22)25-21(28)9-4-13-2-1-3-16(10-13)27(29)30/h1-12H,(H,25,28)/b9-4+
InChIKey
PLUDEBRMNPIPKO-RUDMXATFSA-N
Synonyms
433967-07-8
(2E)N(2(2chloro4fluorophenyl)13benzoxazol5yl)3(3nitrophenyl)prop2enamide
(E)N(2(2CHLORO4FLUOROPHENYL)13BENZOXAZOL5YL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(2(2chloro4fluorophenyl)benzo(d)oxazol5yl)3(3nitrophenyl)acrylamide
433967078
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)F)Cl
InChI=1SC22H13ClFN3O4c23181114(24)5717(18)2226191215(6820(19)3122)2521(28)941321316(1013)27(29)30h112H(H2528)b94+
MFCD03246188
O=C(Nc1ccc2c(c1)nc(o2)c1ccc(cc1Cl)F)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000002226849
ZINC02226849
ZINC2226849

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Available files

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